1-Hexadecylpyridinium bromide

Chemical Properties

Melting point	63-69 °C
storage temp.	Inert atmosphere,Room Temperature
solubility	Chloroform,Methanol,Acetone,Ethanol[soluble in]
solubility	soluble in Chloroform,Methanol,Acetone,Ethanol
form	powder to crystal
color	White to Almost white
Water Solubility	5 g/L (20 ºC)
BRN	3778948
InChI	InChI=1S/C21H38N.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22;/h15,17-18,20-21H,2-14,16,19H2,1H3;1H/q+1;/p-1
InChIKey	DVBJBNKEBPCGSY-UHFFFAOYSA-M
SMILES	[N+]1(CCCCCCCCCCCCCCCC)C=CC=CC=1.[Br-]
LogP	1.699 (est)
CAS DataBase Reference	140-72-7(CAS DataBase Reference)
EPA Substance Registry System	Cetylpyridinium bromide (140-72-7)

Hazard Codes	T+,Xi,Xn
Risk Statements	22-26-36/37/38-20/21/22
Safety Statements	26-28-36/37-45-36/37/39-22-36
RIDADR	2811
WGK Germany	3
RTECS	UU4848000
HazardClass	6.1(b)
PackingGroup	III
HS Code	29333999
Hazardous Substances Data	140-72-7(Hazardous Substances Data)
Toxicity	mouse,LD50,unreported,126mg/kg (126mg/kg),Pharmazie. Vol. 40, Pg. 273, 1985.